![1H-1,2,4-Triazole-1-acetonitrile, alpha-[(propylthio)[4-(trifluoromethyl)phenyl]methyl]-](/api/spectrum/RGLzdsoBVc/structure.png?h=300&w=458 "1H-1,2,4-Triazole-1-acetonitrile, alpha-[(propylthio)[4-(trifluoromethyl)phenyl]methyl]-")
| SpectraBase Compound ID | LsfY8jhWcgw |
|---|---|
| InChI | InChI=1S/C15H15F3N4S/c1-2-7-23-14(13(8-19)22-10-20-9-21-22)11-3-5-12(6-4-11)15(16,17)18/h3-6,9-10,13-14H,2,7H2,1H3 |
| InChIKey | BAHUNJQJAGVWQU-UHFFFAOYSA-N |
| Mol Weight | 340.37 g/mol |
| Molecular Formula | C15H15F3N4S |
| Exact Mass | 340.096952 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | RGLzdsoBVc |
|---|---|
| Name | 1H-1,2,4-Triazole-1-acetonitrile, alpha-[(propylthio)[4-(trifluoromethyl)phenyl]methyl]- |
| CAS Registry Number | 101807-25-4 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C15H15F3N4S |
| InChI | InChI=1S/C15H15F3N4S/c1-2-7-23-14(13(8-19)22-10-20-9-21-22)11-3-5-12(6-4-11)15(16,17)18/h3-6,9-10,13-14H,2,7H2,1H3 |
| InChIKey | BAHUNJQJAGVWQU-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |